Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'ALK tyrosine kinase receptor' and Ligand = 'BDBM243378'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM243378 (2-(6-(5-chloro-4-(2-(isopropylsulfonyl)phenylamino...) Show SMILES COc1cc2CN(CC(=O)N(C)C)CCc2cc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1 Show InChI InChI=1S/C27H33ClN6O4S/c1-17(2)39(36,37)24-9-7-6-8-21(24)30-26-20(28)14-29-27(32-26)31-22-12-18-10-11-34(16-25(35)33(3)4)15-19(18)13-23(22)38-5/h6-9,12-14,17H,10-11,15-16H2,1-5H3,(H2,29,30,31,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of ALK (unknown origin) using peptide substrate incubated for 30 mins in presence of ATP by fluorescence assay				Citation and Details Article DOI: 10.1016/j.bmc.2015.12.004 BindingDB Entry DOI: 10.7270/Q269778Q
					More data for this Ligand-Target Pair
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM243378 (2-(6-(5-chloro-4-(2-(isopropylsulfonyl)phenylamino...) Show SMILES COc1cc2CN(CC(=O)N(C)C)CCc2cc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1 Show InChI InChI=1S/C27H33ClN6O4S/c1-17(2)39(36,37)24-9-7-6-8-21(24)30-26-20(28)14-29-27(32-26)31-22-12-18-10-11-34(16-25(35)33(3)4)15-19(18)13-23(22)38-5/h6-9,12-14,17H,10-11,15-16H2,1-5H3,(H2,29,30,31,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	25
KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY US Patent					Assay Description A proliferation inhibitory activity against the ALK of the compound represented by Chemical Formula 1 according to the present invention at an enzyme...				US Patent US10053458 (2018) BindingDB Entry DOI: 10.7270/Q2ZS2ZH9
					More data for this Ligand-Target Pair
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM243378 (2-(6-(5-chloro-4-(2-(isopropylsulfonyl)phenylamino...) Show SMILES COc1cc2CN(CC(=O)N(C)C)CCc2cc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1 Show InChI InChI=1S/C27H33ClN6O4S/c1-17(2)39(36,37)24-9-7-6-8-21(24)30-26-20(28)14-29-27(32-26)31-22-12-18-10-11-34(16-25(35)33(3)4)15-19(18)13-23(22)38-5/h6-9,12-14,17H,10-11,15-16H2,1-5H3,(H2,29,30,31,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of crizotinib-resistant ALK L1196M mutant (unknown origin) using peptide substrate incubated for 30 mins in presence of ATP by fluorescenc...				Citation and Details Article DOI: 10.1016/j.bmc.2015.12.004 BindingDB Entry DOI: 10.7270/Q269778Q
					More data for this Ligand-Target Pair